methyl (E)-3-bromanyl-4-oxidanylidene-6-phenyl-hex-5-enoate

Systemtic Name: methyl (E)-3-bromanyl-4-oxidanylidene-6-phenyl-hex-5-enoate Openeye Name: methyl (E)-3-bromo-4-oxo-6-phenyl-hex-5-enoate CAS Name: (E)-3-bromo-4-oxo-6-phenyl-5-hexenoic acid methyl ester IUPAC Name: methyl (E)-3-bromo-4-oxo-6-phenylhex-5-enoate Traditional Name: (E)-3-bromo-4-keto-6-phenyl-hex-5-enoic acid methyl ester Formula: C13H13BrO3 MolecularWeight: 297.14452

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(=O)C=CC1=CC=CC=C1)Br

Isomeric SMILES

COC(=O)CC(C(=O)/C=C/C1=CC=CC=C1)Br

InChI

InChI=1S/C13H13BrO3/c1-17-13(16)9-11(14)12(15)8-7-10-5-3-2-4-6-10/h2-8,11H,9H2,1H3/b8-7+